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Heme A

PropertiesImageOccurences in reactions
MNX_IDMNXM1377962Image of MNXM1377962
#reac
in my sandbox 0
in MNXref (generic)7
in models (compartimentalized) 1
formulaC49H56FeN4O6
charge0
mass852.854
referencekeggC:C15670
InChIKeyZGGYGTCPXNDTRV-ONCSLILDSA-L
InChIInChI=1S/C49H58N4O6.Fe/c1-9-34-31(6)39-25-45-49(46(55)18-12-17-30(5)16-11-15-29(4)14-10-13-28(2)3)33(8)40(52-45)24-44-37(27-54)36(20-22-48(58)59)43(53-44)26-42-35(19-21-47(56)57)32(7)38(51-42)23-41(34)50-39;/h9,13,15,17,23-27,46,55H,1,10-12,14,16,18-22H2,2-8H3,(H4,50,51,52,53,54,56,57,58,59);/q;+2/p-2/b29-15+,30-17+,38-23-,39-25-,40-24-,41-23-,42-26-,43-26-,44-24-,45-25-;
SMILES[CH2:1]=[CH:9][C:34]1=[C:31]([CH3:6])[C:39]2=[CH:25][C:45]3=[N:52][C:40](=[CH:24][C:44]4=[N:53][C:43](=[C:36]([CH2:20][CH2:22][C:48](=[O:58])[OH:59])[C:37]4=[CH:27][OH:54])[CH:26]=[c:42]4[c:35]([CH2:19][CH2:21][C:47](=[O:56])[OH:57])[c:32]([CH3:7])/[c:38]([n-:51]4)=[CH:23]/[C:41]1=[NH+:50]2)[C:33]([CH3:8])=[C:49]3[CH:46]([CH2:18][CH2:12]/[CH:17]=[C:30](\[CH3:5])[CH2:16][CH2:11]/[CH:15]=[C:29](\[CH3:4])[CH2:14][CH2:10][CH:13]=[C:28]([CH3:2])[CH3:3])[OH:55].[Fe+2:60]
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Similar chemical compounds in external resources
IdentifierDescription
kegg.compound:C15670
keggC:C15670
Heme A
metacyc.compound:CPD-13734
metacycM:CPD-13734
ferroheme a
seed.compound:cpd11312
seedM:cpd11312
hemeA
Heme A
keggC:M_C15670
seedM:M_cpd11312
secondary/obsolete/fantasy identifier